[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-quinoxalin-6-yl-methanone

Systemtic Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-quinoxalin-6-yl-methanone Openeye Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-quinoxalin-6-yl-methanone CAS Name: [4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-(6-quinoxalinyl)methanone IUPAC Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-quinoxalin-6-ylmethanone Traditional Name: [4-(3,4-dimethylphenyl)sulfonylpiperazino]-quinoxalin-6-yl-methanone Formula: C21H22N4O3S MolecularWeight: 410.48938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=NC=CN=C4C=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=NC=CN=C4C=C3)C

InChI

InChI=1S/C21H22N4O3S/c1-15-3-5-18(13-16(15)2)29(27,28)25-11-9-24(10-12-25)21(26)17-4-6-19-20(14-17)23-8-7-22-19/h3-8,13-14H,9-12H2,1-2H3